Geometry & MOs

Info

ID:	378500
PubChem CID:	134224586
Reduced:	ON2C19H24 (1)
Stoich.:	AB2C19D24 (1)
Weight, g/mol:	277.186421
ΔH_f, kcal/mol:	29.95
Dipole, Da:	2.9
IP(EA), eV:	-9.44(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1S,3S)-3-butan-2-yl-2,2-dimethylcyclopropyl]-2-cyclopentyl-1,3-thiazole

Drug info:

PubChemData

Smile

CCC(C)C1C(C12CCCC2)C3=NC(=NO3)C4=CC=CC=C4

DOS

IR

Vibrations